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79403-36-4 | Stannane,tributyl[(1-oxo-2,4-hexadienyl)oxy]-, (E,E)- (9CI)
CAS No: 79403-36-4 Catalog No: AG005K6U MDL No:
Product Description
Catalog Number:
AG005K6U
Chemical Name:
Stannane,tributyl[(1-oxo-2,4-hexadienyl)oxy]-, (E,E)- (9CI)
CAS Number:
79403-36-4
Molecular Formula:
C18H34O2Sn
Molecular Weight:
401.1624
IUPAC Name:
tributylstannyl hexa-2,4-dienoate
InChI:
InChI=1S/C6H8O2.3C4H9.Sn/c1-2-3-4-5-6(7)8;3*1-3-4-2;/h2-5H,1H3,(H,7,8);3*1,3-4H2,2H3;/q;;;;+1/p-1
InChI Key:
GCNHNMQPMBJDHL-UHFFFAOYSA-M
SMILES:
CCCC[Sn](OC(=O)/C=C/C=C/C)(CCCC)CCCC
EC Number:
279-149-0
Properties
Complexity:
299
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
402.158g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
401.178g/mol
Monoisotopic Mass:
402.158g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
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